(2S)-3-[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-methyl-propanenitrile

Systemtic Name: (2S)-3-[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-methyl-propanenitrile Openeye Name: (2S)-3-[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-methyl-propanenitrile CAS Name: (2S)-3-[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-2-methylpropanenitrile IUPAC Name: (2S)-3-[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-methylpropanenitrile Traditional Name: (2S)-3-[[4-cyclohexyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-2-methyl-propionitrile Formula: C19H24N4OS MolecularWeight: 356.48506

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=NN=C(N1C2CCCCC2)C3=CC=C(C=C3)OC)C#N

Isomeric SMILES

C[C@H](CSC1=NN=C(N1C2CCCCC2)C3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C19H24N4OS/c1-14(12-20)13-25-19-22-21-18(15-8-10-17(24-2)11-9-15)23(19)16-6-4-3-5-7-16/h8-11,14,16H,3-7,13H2,1-2H3/t14-/m0/s1